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dibenzyl (2R,5S)-2-(t-butyl)-3-methoxycarbonyl-1,3-(oxazolidin-5-yl)malonate
SpectraBase Compound ID aUgvTbGZw6
InChI InChI=1S/C26H31NO7/c1-26(2,3)24-27(25(30)31-4)15-20(34-24)21(22(28)32-16-18-11-7-5-8-12-18)23(29)33-17-19-13-9-6-10-14-19/h5-14,20-21,24H,15-17H2,1-4H3/t20-,24-/m1/s1
InChIKey LQHFIPYSPHWOGV-HYBUGGRVSA-N
Mol Weight 469.53 g/mol
Molecular Formula C26H31NO7
Exact Mass 469.210052 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPuIsEyzXnc
Name dibenzyl (2R,5S)-2-(t-butyl)-3-methoxycarbonyl-1,3-(oxazolidin-5-yl)malonate
Alternate Name(s) dibenzyl 2-[(2R,5S)-2-tert-butyl-3-(methoxycarbonyl)-1,3-oxazolidin-5-yl]malonate
CAS Registry Number 122697-89-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31NO7
InChI InChI=1S/C26H31NO7/c1-26(2,3)24-27(25(30)31-4)15-20(34-24)21(22(28)32-16-18-11-7-5-8-12-18)23(29)33-17-19-13-9-6-10-14-19/h5-14,20-21,24H,15-17H2,1-4H3/t20-,24-/m1/s1
InChIKey LQHFIPYSPHWOGV-HYBUGGRVSA-N
Molecular Weight 469.534 g/mol
SMILES [C@@]1(N(C[C@@](O1)(C(C(OCc1ccccc1)=O)C(OCc1ccccc1)=O)[H])C(=O)OC)(C(C)(C)C)[H]
SPLASH splash10-006x-9000400000-994567235aff84d65899
Source of Spectrum K-122-2373-35
Wiley ID 1392645